Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](NC2=C(C=C(Cl)C=C2)C(=O)C2=CC=CC=C2Cl)C2=CC3=C(OCO3)C=C12
InChIKey
InChIKey=JPTYRQOYOGPYKK-FPMZXNSHSA-N
Formula
C35H29Cl2NO8
Mass
662.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lignans, neolignans and related compounds
- Class Lignan lactones
-
Superclass
Lignans, neolignans and related compounds
Kingdom
Organic compounds
Superclass
Lignans, neolignans and related compounds
Class
Lignan lactones
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Lignan lactones
Alternative Parents
Tametralines Aryltetralin lignans Furanonaphthodioxoles Benzophenones Aryl-phenylketones Diphenylmethanes Benzodioxoles Aniline and substituted anilines Anisoles Phenylalkylamines Phenoxy compounds Benzoyl derivatives Methoxybenzenes Alkyl aryl ethers Secondary alkylarylamines Chlorobenzenes Aryl chlorides Gamma butyrolactones Tetrahydrofurans Vinylogous amides Vinylogous halides Carboxylic acid esters Amino acids and derivatives Monocarboxylic acids and derivatives Oxacyclic compounds Acetals Organic oxides Organochlorides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Lignan lactone - Tametraline - 1-aryltetralin lignan - Linear furanonaphthodioxole - Benzophenone - Aryl-phenylketone - Naphthofuran - Diphenylmethane - Tetralin - Benzodioxole - Phenoxy compound - Anisole - Phenol ether - Aryl ketone - Benzoyl - Phenylalkylamine - Aniline or substituted anilines - Methoxybenzene - Chlorobenzene - Secondary aliphatic/aromatic amine - Aralkylamine - Halobenzene - Alkyl aryl ether - Aryl chloride - Gamma butyrolactone - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Vinylogous halide - Tetrahydrofuran - Amino acid or derivatives - Lactone - Carboxylic acid ester - Ketone - Acetal - Oxacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Organooxygen compound - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organopnictogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as lignan lactones. These are lignans that contain a lactone moiety. They include 1-aryltetralin lactones, dibenzylbutyrolactone lignans, and podophyllotoxins, among others.
External Descriptors
Not available